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Home > Nitro Compounds > 597-45-5
597-45-5 | 2-Nitro-2,4-dimethylpentane
CAS No: 597-45-5 Catalog No: AG00EZKA MDL No:
Product Description
Catalog Number:
AG00EZKA
Chemical Name:
2-Nitro-2,4-dimethylpentane
CAS Number:
597-45-5
IUPAC Name:
2,4-dimethyl-2-nitropentane
InChI:
InChI=1S/C7H15NO2/c1-6(2)5-7(3,4)8(9)10/h6H,5H2,1-4H3
InChI Key:
JOTFJIBCIJGTAS-UHFFFAOYSA-N
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.11g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.202g/mol
Monoisotopic Mass:
145.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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